source: src/Actions@ 8f4df1

Action_Thermostats Add_AtomRandomPerturbation Add_FitFragmentPartialChargesAction Add_RotateAroundBondAction Add_SelectAtomByNameAction Added_ParseSaveFragmentResults AddingActions_SaveParseParticleParameters Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_ParticleName_to_Atom Adding_StructOpt_integration_tests AtomFragments Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.5.4 Candidate_v1.6.0 Candidate_v1.6.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator CombiningParticlePotentialParsing Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_BoundInBox_CenterInBox_MoleculeActions Fix_ChargeSampling_PBC Fix_ChronosMutex Fix_FitPartialCharges Fix_FitPotential_needs_atomicnumbers Fix_ForceAnnealing Fix_IndependentFragmentGrids Fix_ParseParticles Fix_ParseParticles_split_forward_backward_Actions Fix_PopActions Fix_QtFragmentList_sorted_selection Fix_Restrictedkeyset_FragmentMolecule Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns Fix_fitting_potentials Fixes ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion FragmentAction_writes_AtomFragments FragmentMolecule_checks_bonddegrees GeometryObjects Gui_Fixes Gui_displays_atomic_force_velocity ImplicitCharges IndependentFragmentGrids IndependentFragmentGrids_IndividualZeroInstances IndependentFragmentGrids_IntegrationTest IndependentFragmentGrids_Sole_NN_Calculation JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix MoreRobust_FragmentAutomation ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PdbParser_setsAtomName PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks Rewrite_FitPartialCharges RotateToPrincipalAxisSystem_UndoRedo SaturateAtoms_findBestMatching SaturateAtoms_singleDegree StoppableMakroAction Subpackage_CodePatterns Subpackage_JobMarket Subpackage_LinearAlgebra Subpackage_levmar Subpackage_mpqc_open Subpackage_vmg Switchable_LogView ThirdParty_MPQC_rebuilt_buildsystem TrajectoryDependenant_MaxOrder TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps TremoloParser_setsAtomName Ubuntu_1604_changes stable
Name Size Rev Age Author Last Change
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AnalysisAction 6e5084   14 years FrederikHeber Fixed PrincipalAxisSystemAction. - …
AtomAction dddbfe   14 years FrederikHeber FIX: XyzParser::Load() did not create a molecule wherein all atoms …
CmdAction 952f38   14 years FrederikHeber created LibMolecuilderHelpers. - is shared - renamed log.[ch]pp -> …
FragmentationAction 952f38   14 years FrederikHeber created LibMolecuilderHelpers. - is shared - renamed log.[ch]pp -> …
MoleculeAction 90bc51   14 years FrederikHeber FIX: RotateAroundSelfByAngleAction also gets position, using a …
ParserAction 952f38   14 years FrederikHeber created LibMolecuilderHelpers. - is shared - renamed log.[ch]pp -> …
SelectionAction 952f38   14 years FrederikHeber created LibMolecuilderHelpers. - is shared - renamed log.[ch]pp -> …
TesselationAction 952f38   14 years FrederikHeber created LibMolecuilderHelpers. - is shared - renamed log.[ch]pp -> …
WorldAction 952f38   14 years FrederikHeber created LibMolecuilderHelpers. - is shared - renamed log.[ch]pp -> …
Action.cpp 2.0 KB ​ 952f38   14 years FrederikHeber created LibMolecuilderHelpers. - is shared - renamed log.[ch]pp -> …
Action.hpp 20.6 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
ActionHistory.cpp 3.3 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
ActionHistory.hpp 2.1 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
ActionRegistry.cpp 938 bytes ​ b2d8d0   14 years FrederikHeber Registry pattern split off of ActionRegistry, the latter converted to …
ActionRegistry.hpp 823 bytes ​ b2d8d0   14 years FrederikHeber Registry pattern split off of ActionRegistry, the latter converted to …
ActionSequence.cpp 3.4 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
ActionSequence.hpp 796 bytes ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
AtomsCalculation.hpp 610 bytes ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
AtomsCalculation_impl.hpp 1.2 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
Calculation.hpp 1.7 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
Calculation_impl.hpp 1.5 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
ErrorAction.cpp 998 bytes ​ 952f38   14 years FrederikHeber created LibMolecuilderHelpers. - is shared - renamed log.[ch]pp -> …
ErrorAction.hpp 654 bytes ​ 80951de   14 years FrederikHeber Fixed all remaining Action's and derived classes that lacked …
Makefile.am 8.5 KB ​ eaf4ae   14 years FrederikHeber Added two new actions. - RotateAroundOriginByAngle: Rotates around a …
MakroAction.cpp 1.9 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
MakroAction.hpp 851 bytes ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
ManipulateAtomsProcess.cpp 1.6 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
ManipulateAtomsProcess.hpp 939 bytes ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
MapOfActions.cpp 46.4 KB ​ eaf4ae   14 years FrederikHeber Added two new actions. - RotateAroundOriginByAngle: Rotates around a …
MapOfActions.hpp 9.7 KB ​ 0bb05a   14 years FrederikHeber BUGFIX: include for boost/lexical_cast.hpp was missing.
MethodAction.cpp 1.1 KB ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
MethodAction.hpp 871 bytes ​ 047878   14 years Till Crueger made all actions pass on the dialogs and add the corresponding queries
Process.cpp 1.9 KB ​ da3024   15 years FrederikHeber Fixed various compiler warnings. - Process::Process() - Action and …
Process.hpp 2.2 KB ​ 2efa90   15 years Till Crueger Added detailed documentation for the Action class
Values.hpp 303 bytes ​ 8467df   14 years FrederikHeber BUGFIX: BoxValue were upper not lower tridiagonal. Due to pcp's …
ValueStorage.cpp 389 bytes ​ 861874   14 years FrederikHeber libMolecuilderAction is now a shared lib via libtool. This is all …
ValueStorage.hpp 991 bytes ​ 861874   14 years FrederikHeber libMolecuilderAction is now a shared lib via libtool. This is all …
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